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Journals in DBLP

Journal of Computational Chemistry
1996, volume: 17, number: 11

  1. Marc F. Lensink, Janez Mavri, Herman J. C. Berendsen
    Simultaneous integration of mixed quantum-classical systems by density matrix evolution equations using interaction representation and adaptive time step integrator. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1287-1295 [Journal]
  2. Romano T. Kroemer, Peter Hecht, Klaus R. Liedl
    Different electrostatic descriptors in comparative molecular field analysis: A comparison of molecular electrostatic and coulomb potentials. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1296-1308 [Journal]
  3. Oscar N. Ventura, Martina Kieninger, Elena L. Coitiño
    Density functional study of isomerization of fluoro- and chloroformaldehyde radical cations. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1309-1317 [Journal]
  4. Serguei Patchkovskii, Walter Thiel
    Analytical second derivatives of the energy in MNDO methods. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1318-1327 [Journal]
  5. N. Swamy Kandadai, M. Rami Reddy
    Solution structure of papain as studied by molecular mechanics and molecular dynamics techniques. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1328-1338 [Journal]
  6. Sean A. C. McDowell
    Dipole moment derivatives and integrated intensities for the vibrational transitions of N2 HF. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1339-1343 [Journal]
  7. Zhongxiang Zhou, Philip Payne, Max Vasquez, Nat Kuhn, Michael Levitt
    Finite-difference solution of the Poisson-Boltzmann equation: Complete elimination of self-energy. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1344-1351 [Journal]
  8. Jerzy Cioslowski, Boris B. Stefanov, Pere Constans
    Efficient algorithm for quantitative assessment of similarities among atoms in molecules. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1352-1358 [Journal]
  9. Marc Couty, Michael B. Hall
    Basis sets for transition metals: Optimized outer p functions. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1359-1370 [Journal]
  10. Jorge Llano, Luis A. Montero
    Bonding contribution to restricted internal rotations in saccharides. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1371-1384 [Journal]
  11. Julian Tirado-Rives, William L. Jorgensen
    Viability of molecular modeling with pentium-based PCs. [Citation Graph (0, 0)][DBLP]
    Journal of Computational Chemistry, 1996, v:17, n:11, pp:1385-1386 [Journal]
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